Detailed information for compound 606927

Basic information

Technical information
  • TDR Targets ID: 606927
  • Name: 4-amino-2-[(2-methylphenyl)amino]-5-(4-nitrob enzoyl)-N-phenylthiophene-3-carboxamide
  • MW: 472.516 | Formula: C25H20N4O4S
  • H donors: 3 H acceptors: 4 LogP: 6.6 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1sc(c(c1N)C(=O)Nc1ccccc1)Nc1ccccc1C)c1ccc(cc1)[N+](=O)[O-]
  • InChi: 1S/C25H20N4O4S/c1-15-7-5-6-10-19(15)28-25-20(24(31)27-17-8-3-2-4-9-17)21(26)23(34-25)22(30)16-11-13-18(14-12-16)29(32)33/h2-14,28H,26H2,1H3,(H,27,31)
  • InChiKey: NIKAZODXIQBYJT-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-amino-2-[(2-methylphenyl)amino]-5-(4-nitrobenzoyl)-N-phenyl-thiophene-3-carboxamide
  • 4-amino-2-[(2-methylphenyl)amino]-5-[(4-nitrophenyl)-oxomethyl]-N-phenyl-3-thiophenecarboxamide
  • 4-amino-2-[(2-methylphenyl)amino]-5-(4-nitrophenyl)carbonyl-N-phenyl-thiophene-3-carboxamide
  • EU-0061027

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni hypothetical protein 0.0363 0.1393 0.2548
Loa Loa (eye worm) hypothetical protein 0.0151 0.0553 1
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.009 0.0314 1
Onchocerca volvulus Bile acid receptor homolog 0.0025 0.0055 0.3586
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0025 0.0055 0.0951
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.00250592 0.5 0.5
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.00250592 0.5 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.009 0.0314 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.00250592 0.5 0.5
Schistosoma mansoni fkbp-rapamycin associated protein 0.0017 0.0023 0.0038
Onchocerca volvulus 0.003 0.0074 0.4939
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0048 0.0145 0.0261
Leishmania major mitochondrial DNA polymerase beta 0.0298 0.1135 1
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.00250592 0.5 0.5
Loa Loa (eye worm) hypothetical protein 0.0012 0.0002 0.0039
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0025 0.0055 0.0951
Loa Loa (eye worm) hypothetical protein 0.0012 0.0002 0.0039
Echinococcus granulosus nuclear receptor 2DBD gamma 0.00250592 0.5 0.5
Schistosoma mansoni coup transcription factor 0.0025 0.0055 0.0096
Schistosoma mansoni cellular tumor antigen P53 0.0049 0.0148 0.0268
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.00250592 0.5 0.5
Echinococcus granulosus FTZ F1 alpha 0.00250592 0.5 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0008 0.0247
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0025 0.0055 0.0096
Schistosoma mansoni tar DNA-binding protein 0.0127 0.0458 0.0835
Loa Loa (eye worm) hypothetical protein 0.00250592 0.5 0.5
Echinococcus granulosus serine:threonine protein kinase SMG1 0.0017 0.0023 0.0038
Brugia malayi Nuclear hormone receptor family member nhr-3 0.00250592 0.5 0.5
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0042 0.0121 0.0984
Trichomonas vaginalis PIKK family atypical protein kinase 0.009 0.0314 1
Schistosoma mansoni RAR-like nuclear receptor 0.0025 0.0055 0.0096
Echinococcus multilocularis serine:threonine protein kinase SMG1 0.0017 0.0023 0.0021
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0013 0.0008 0.001
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.009 0.0314 0.2697
Loa Loa (eye worm) hypothetical protein 0.0025 0.0055 0.0987
Echinococcus multilocularis FTZ F1 alpha 0.00250592 0.5 0.5
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0025 0.0055 0.0951
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.0017 0.0023 0.0038
Trichomonas vaginalis PIKK family atypical protein kinase 0.0054 0.0167 0.5335
Echinococcus multilocularis geminin 0.0363 0.1393 0.1391
Trichomonas vaginalis PIKK family atypical protein kinase 0.0067 0.0222 0.7073
Brugia malayi Nuclear hormone receptor family member nhr-41 0.00250592 0.5 0.5
Schistosoma mansoni coup transcription factor 0.00250592 0.5 0.5
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.009 0.0314 0.0312
Trichomonas vaginalis PIKK family atypical protein kinase 0.0072 0.024 0.7663
Loa Loa (eye worm) hypothetical protein 0.0012 0.0002 0.0039
Loa Loa (eye worm) hypothetical protein 0.0103 0.0364 0.6581
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0025 0.0055 0.0096
Trichomonas vaginalis PIKK family atypical protein kinase 0.0049 0.0149 0.4745
Trichomonas vaginalis PIKK family atypical protein kinase 0.0054 0.0169 0.5402
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0025 0.0055 0.0096
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0035 0.0221
Trichomonas vaginalis PIKK family atypical protein kinase 0.0049 0.0149 0.4735
Loa Loa (eye worm) nuclear hormone receptor 0.0012 0.0002 0.0039
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0025 0.0055 0.0052
Echinococcus granulosus dnaJ subfamily B 0.0428 0.1652 0.3023
Brugia malayi Nuclear hormone receptor family member nhr-49 0.00250592 0.5 0.5
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.009 0.0314 0.2765
Brugia malayi ImpB/MucB/SamB family protein 0.002 0.0035 0.0602
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0025 0.0055 0.0052
Echinococcus granulosus tar DNA binding protein 0.0127 0.0458 0.0835
Trichomonas vaginalis PIKK family atypical protein kinase 0.003 0.0076 0.2407
Toxoplasma gondii non-specific serine/threonine protein kinase 0.0019 0.0031 0.039
Loa Loa (eye worm) hypothetical protein 0.0013 0.0008 0.0141
Schistosoma mansoni thyroid hormone receptor 0.0025 0.0055 0.0096
Trichomonas vaginalis PIKK family atypical protein kinase 0.0067 0.0222 0.7073
Loa Loa (eye worm) nuclear receptor NHR-67 0.0012 0.0002 0.0039
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.00250592 0.5 0.5
Loa Loa (eye worm) hypothetical protein 0.00250592 0.5 0.5
Loa Loa (eye worm) hypothetical protein 0.00250592 0.5 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0072 0.024 0.7663
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0035 0.0221
Schistosoma mansoni retinoic acid receptor RXR 0.0025 0.0055 0.0096
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.00250592 0.5 0.5
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0012 0.0002 0.0039
Brugia malayi Steroid receptor seven-up type 2 0.0025 0.0055 0.0951
Brugia malayi steroid hormone receptor 0.0025 0.0055 0.0951
Brugia malayi RNA recognition motif domain containing protein 0.0127 0.0458 0.8261
Loa Loa (eye worm) hypothetical protein 0.002 0.0035 0.0639
Loa Loa (eye worm) hypothetical protein 0.0049 0.0148 0.2682
Loa Loa (eye worm) hypothetical protein 0.0012 0.0002 0.0039
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0025 0.0055 0.0951
Loa Loa (eye worm) CXXC zinc finger family protein 0.003 0.0074 0.1345
Brugia malayi MH2 domain containing protein 0.0121 0.0436 0.7864
Echinococcus multilocularis ecdysone induced protein 78C 0.0025 0.0055 0.0052
Brugia malayi nuclear hormone receptor 0.00250592 0.5 0.5
Echinococcus granulosus GPCR family 2 0.0048 0.0145 0.0261
Trichomonas vaginalis PIKK family atypical protein kinase 0.0054 0.0167 0.5335
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0017 0.0023 0.0204
Onchocerca volvulus 0.00250592 0.5 0.5
Echinococcus granulosus tumor protein p63 0.0333 0.1275 0.2332
Brugia malayi TAR-binding protein 0.0127 0.0458 0.8261
Trichomonas vaginalis PIKK family atypical protein kinase 0.0067 0.0222 0.7073
Brugia malayi Nuclear hormone receptor family member nhr-25 0.00250592 0.5 0.5
Loa Loa (eye worm) hypothetical protein 0.00250592 0.5 0.5
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.00250592 0.5 0.5
Loa Loa (eye worm) hypothetical protein 0.0025 0.0055 0.0987
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0141 0.0513 0.4349
Brugia malayi Nuclear hormone receptor-like 1 0.00250592 0.5 0.5
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.009 0.0314 0.2765
Leishmania major phosphatidylinositol 3-related kinase, putative 0.003 0.0076 0.0365
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.00250592 0.5 0.5
Echinococcus multilocularis dnaJ subfamily B 0.0428 0.1652 0.165
Brugia malayi Nuclear hormone receptor-like 1 0.0025 0.0055 0.0951
Trichomonas vaginalis PIKK family atypical protein kinase 0.0067 0.0222 0.7073
Schistosoma mansoni DNA polymerase eta 0.002 0.0035 0.0061
Schistosoma mansoni Tr4/Tr2 (homologue) 0.00250592 0.5 0.5
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.002 0.0035 0.1127
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0298 0.1135 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0025 0.0055 0.0951
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0035 0.0221
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0048 0.0145 0.2583
Trichomonas vaginalis PIKK family atypical protein kinase 0.0049 0.0149 0.4735
Trichomonas vaginalis PIKK family atypical protein kinase 0.0049 0.0149 0.4745
Onchocerca volvulus 0.0025 0.0055 0.3586
Echinococcus granulosus ecdysone induced protein 78C 0.00250592 0.5 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.00250592 0.5 0.5
Loa Loa (eye worm) hypothetical protein 0.0013 0.0008 0.0141
Echinococcus granulosus FTZ F1 alpha 0.0025 0.0055 0.0096
Trichomonas vaginalis PIKK family atypical protein kinase 0.0061 0.0196 0.6239
Trichomonas vaginalis PIKK family atypical protein kinase 0.0017 0.0023 0.0737
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0025 0.0055 0.0987
Echinococcus multilocularis thyroid hormone receptor alpha 0.0025 0.0055 0.0052
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0048 0.0145 0.0142
Brugia malayi RNA binding protein 0.0127 0.0458 0.8261
Brugia malayi CXXC zinc finger family protein 0.003 0.0074 0.1311
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0127 0.0458 0.8267
Schistosoma mansoni cpg binding protein 0.0032 0.0081 0.0145
Trichomonas vaginalis PIKK family atypical protein kinase 0.003 0.0076 0.2407
Schistosoma mansoni tar DNA-binding protein 0.0127 0.0458 0.0835
Trypanosoma brucei unspecified product 0.002 0.0035 0.0221
Trypanosoma brucei phosphatidylinositol kinase related protein, putative 0.0017 0.0023 0.0112
Toxoplasma gondii histone lysine methyltransferase SET1 0.0057 0.0181 0.7941
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0025 0.0055 0.0096
Trichomonas vaginalis PIKK family atypical protein kinase 0.0077 0.0261 0.833
Trichomonas vaginalis PIKK family atypical protein kinase 0.0059 0.0188 0.5992
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0025 0.0055 0.0096
Schistosoma mansoni cpg binding protein 0.003 0.0074 0.0132
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.00250592 0.5 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.00250592 0.5 0.5
Schistosoma mansoni thyroid hormone receptor 0.00250592 0.5 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0051 0.1641
Brugia malayi nuclear receptor NHR-88 0.00250592 0.5 0.5
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.003 0.0076 0.0666
Echinococcus multilocularis microtubule associated protein 2 0.1389 0.5458 0.5457
Loa Loa (eye worm) hypothetical protein 0.00250592 0.5 0.5
Loa Loa (eye worm) hypothetical protein 0.0018 0.0028 0.0513
Loa Loa (eye worm) hypothetical protein 0.00250592 0.5 0.5
Loa Loa (eye worm) hypothetical protein 0.0012 0.0002 0.0039
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0072 0.0241 0.2047
Echinococcus multilocularis ecdysone induced protein 78C 0.00250592 0.5 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0049 0.0149 0.4735
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.00250592 0.5 0.5
Schistosoma mansoni tar DNA-binding protein 0.0127 0.0458 0.0835
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0025 0.0055 0.3586
Schistosoma mansoni retinoid-x-receptor (RXR) 0.00250592 0.5 0.5
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0025 0.0055 0.0096
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0025 0.0055 0.0987
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0035 0.0312
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.00250592 0.5 0.5
Loa Loa (eye worm) RNA binding protein 0.0127 0.0458 0.8267
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0043 0.0125 0.1017
Trichomonas vaginalis DNA polymerase eta, putative 0.002 0.0035 0.1127
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.00250592 0.5 0.5
Loa Loa (eye worm) hypothetical protein 0.0025 0.0055 0.0987
Brugia malayi Latrophilin receptor protein 2 0.0048 0.0145 0.2583
Trichomonas vaginalis PIKK family atypical protein kinase 0.0067 0.0222 0.7073
Trypanosoma cruzi target of rapamycin kinase 3 0.0072 0.0241 0.2121
Loa Loa (eye worm) hypothetical protein 0.0012 0.0002 0.0039
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.002 0.0035 0.0061
Trichomonas vaginalis PIKK family atypical protein kinase 0.003 0.0076 0.2407
Schistosoma mansoni steroid hormone receptor ad4bp 0.00250592 0.5 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.0151 0.0553 1
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0035 0.0221
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.003 0.0076 0.133
Schistosoma mansoni tar DNA-binding protein 0.0127 0.0458 0.0835
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0048 0.0145 0.0142
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0038 0.0104 0.0833
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0017 0.0023 0.038
Echinococcus granulosus ecdysone induced protein 78C 0.0025 0.0055 0.0096
Brugia malayi steroid hormone receptor 0.00250592 0.5 0.5
Loa Loa (eye worm) hypothetical protein 0.0025 0.0055 0.0987
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0025 0.0055 0.0052
Echinococcus granulosus dna polymerase eta 0.002 0.0035 0.0061
Loa Loa (eye worm) phosphatidylinositol 3 0.003 0.0076 0.1365
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.003 0.0076 0.0578
Echinococcus multilocularis dna polymerase eta 0.002 0.0035 0.0033
Schistosoma mansoni thyroid hormone receptor 0.00250592 0.5 0.5
Trypanosoma cruzi DNA polymerase eta, putative 0.002 0.0035 0.0312
Loa Loa (eye worm) hypothetical protein 0.0048 0.0145 0.2612
Entamoeba histolytica deoxycytidyl transferase, putative 0.002 0.0035 0.0421
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0025 0.0055 0.0951
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0151 0.0553 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0002 0.0039
Brugia malayi Nuclear hormone receptor family member nhr-25 0.00250592 0.5 0.5
Schistosoma mansoni microtubule-associated protein tau 0.1389 0.5458 1
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0042 0.0121 0.1068
Loa Loa (eye worm) hypothetical protein 0.0025 0.0055 0.0987
Loa Loa (eye worm) hypothetical protein 0.0019 0.0031 0.0558
Brugia malayi nuclear receptor NHR-88 0.0025 0.0055 0.0951
Loa Loa (eye worm) DR-78 0.0012 0.0002 0.0039
Brugia malayi Nuclear hormone receptor-like 1 0.0013 0.0008 0.0102
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.00250592 0.5 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0049 0.0149 0.4745
Echinococcus granulosus microtubule associated protein 2 0.1389 0.5458 1
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0025 0.0055 0.0987
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.009 0.0314 0.2532
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.003 0.0076 0.0134
Echinococcus granulosus nuclear receptor 2DBD gamma 0.00250592 0.5 0.5
Brugia malayi Steroid receptor seven-up type 2 0.00250592 0.5 0.5
Loa Loa (eye worm) hypothetical protein 0.0012 0.0002 0.0039
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0072 0.0241 0.1868
Trichomonas vaginalis PIKK family atypical protein kinase 0.009 0.0314 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0064 0.0208 0.0377
Brugia malayi FAT domain containing protein 0.0013 0.0008 0.0101
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0035 0.0221
Mycobacterium tuberculosis Conserved hypothetical protein 0.0157 0.0577 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0002 0.0039
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0025 0.0055 0.0987
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0141 0.0513 0.4525
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0025 0.0055 0.0951
Brugia malayi Nuclear hormone receptor-like 1 0.0013 0.0008 0.0102
Loa Loa (eye worm) hypothetical protein 0.0012 0.0002 0.0039
Trichomonas vaginalis PIKK family atypical protein kinase 0.0017 0.0023 0.0737
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0035 0.0221
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.00250592 0.5 0.5
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0025 0.0055 0.0951
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0017 0.0023 0.0204
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0025 0.0055 0.0096
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0025 0.0055 0.0096
Onchocerca volvulus Protein ultraspiracle homolog 0.00250592 0.5 0.5
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.003 0.0076 0.0578
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0298 0.1135 1
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.00250592 0.5 0.5
Toxoplasma gondii hypothetical protein 0.0048 0.0146 0.616
Trypanosoma brucei DNA polymerase eta, putative 0.002 0.0035 0.0221
Echinococcus granulosus cpg binding protein 0.0032 0.0081 0.0145
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0151 0.0553 1
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0035 0.0221
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0035 0.0221
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0035 0.0221
Trichomonas vaginalis PIKK family atypical protein kinase 0.0072 0.024 0.7663
Loa Loa (eye worm) TAR-binding protein 0.0127 0.0458 0.8267
Loa Loa (eye worm) steroid hormone receptor 0.0025 0.0055 0.0987
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0025 0.0055 0.0987
Echinococcus multilocularis PIK kinase, FAT and Armadillo domain containing protein 0.0013 0.0008 0.0006
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0013 0.0008 0.0141
Brugia malayi latrophilin 2 splice variant baaae 0.0103 0.0364 0.6567
Trichomonas vaginalis PIKK family atypical protein kinase 0.0072 0.024 0.7663
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0025 0.0055 0.0052
Trichomonas vaginalis PIKK family atypical protein kinase 0.0067 0.0222 0.7073
Trichomonas vaginalis PIKK family atypical protein kinase 0.0049 0.0149 0.4745
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.009 0.0314 0.0571
Schistosoma mansoni hypothetical protein 0.0363 0.1393 0.2548
Onchocerca volvulus Protein ultraspiracle homolog 0.0025 0.0055 0.3586
Schistosoma mansoni thyroid hormone receptor 0.0025 0.0055 0.0096
Schistosoma mansoni terminal deoxycytidyl transferase 0.002 0.0035 0.0061
Brugia malayi ecdysteroid receptor 0.00250592 0.5 0.5
Echinococcus multilocularis serine protein kinase ATM 0.0017 0.0023 0.0021
Onchocerca volvulus Bile acid receptor homolog 0.00250592 0.5 0.5
Echinococcus granulosus retinoic acid receptor rxr beta a 0.00250592 0.5 0.5
Echinococcus granulosus geminin 0.0363 0.1393 0.2548
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0013 0.0008 0.0006
Onchocerca volvulus 0.0049 0.0148 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0025 0.0055 0.0951
Brugia malayi Nuclear hormone receptor family member nhr-19 0.00250592 0.5 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.003 0.0076 0.2407
Echinococcus multilocularis dna polymerase kappa 0.002 0.0035 0.0033
Brugia malayi Nuclear hormone receptor family member nhr-1 0.00250592 0.5 0.5
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0035 0.0221
Schistosoma mansoni hypothetical protein 0.0048 0.0145 0.0261
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0025 0.0055 0.0951
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.002 0.0035 0.0061
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.003 0.0076 0.0134
Schistosoma mansoni hypothetical protein 0.0048 0.0145 0.0261
Loa Loa (eye worm) hypothetical protein 0.0012 0.0002 0.0039
Brugia malayi Nuclear hormone receptor family member nhr-31 0.00250592 0.5 0.5
Schistosoma mansoni cpg binding protein 0.0032 0.0081 0.0145
Echinococcus granulosus PIK kinase FAT and Armadillo domain containing protein 0.0013 0.0008 0.001
Trichomonas vaginalis PIKK family atypical protein kinase 0.0054 0.0169 0.5402
Schistosoma mansoni nuclear hormone receptor 0.0025 0.0055 0.0096
Brugia malayi ecdysteroid receptor 0.0025 0.0055 0.0951
Echinococcus multilocularis GPCR, family 2 0.0048 0.0145 0.0142
Trichomonas vaginalis PIKK family atypical protein kinase 0.0067 0.0222 0.7073
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0025 0.0055 0.0052
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.003 0.0076 0.0666
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.00250592 0.5 0.5
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.009 0.0314 0.2697
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.009 0.0314 1
Brugia malayi hypothetical protein 0.0013 0.0008 0.0102
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0031 0.0984
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0025 0.0055 0.0951
Loa Loa (eye worm) latrophilin receptor protein 2 0.0048 0.0145 0.2612
Schistosoma mansoni nuclear hormone receptor 0.00250592 0.5 0.5
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0141 0.0513 0.4474
Giardia lamblia GTOR 0.009 0.0314 1
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0025 0.0055 0.0052
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0025 0.0055 0.0987
Loa Loa (eye worm) hypothetical protein 0.0013 0.0008 0.0141
Trichomonas vaginalis PIKK family atypical protein kinase 0.0054 0.0169 0.5402
Echinococcus granulosus dna polymerase kappa 0.002 0.0035 0.0061
Loa Loa (eye worm) hypothetical protein 0.0013 0.0008 0.014
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.00250592 0.5 0.5
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0025 0.0055 0.0096
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0025 0.0055 0.0096
Loa Loa (eye worm) hypothetical protein 0.00250592 0.5 0.5
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0025 0.0055 0.0096
Loa Loa (eye worm) hypothetical protein 0.0017 0.0023 0.0418
Schistosoma mansoni tar DNA-binding protein 0.0127 0.0458 0.0835
Brugia malayi Nuclear hormone receptor family member nhr-19 0.00250592 0.5 0.5
Brugia malayi hypothetical protein 0.0013 0.0008 0.0102
Brugia malayi Nuclear hormone receptor family member nhr-14 0.00250592 0.5 0.5
Loa Loa (eye worm) hypothetical protein 0.0025 0.0055 0.0987
Loa Loa (eye worm) hypothetical protein 0.0013 0.0008 0.0141
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.002 0.0035 0.0033
Brugia malayi Nuclear hormone receptor family member nhr-40 0.00250592 0.5 0.5
Loa Loa (eye worm) steroid hormone receptor 0.00250592 0.5 0.5
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.00250592 0.5 0.5
Echinococcus multilocularis tumor protein p63 0.0333 0.1275 0.1273
Schistosoma mansoni hypothetical protein 0.0103 0.0364 0.0664
Schistosoma mansoni hypothetical protein 0.0428 0.1652 0.3023
Mycobacterium ulcerans hypothetical protein 0.0157 0.0577 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.003 0.0076 0.2407
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.00250592 0.5 0.5
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.009 0.0314 0.2532
Schistosoma mansoni steroid hormone receptor ad4bp 0.0025 0.0055 0.0096
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0025 0.0055 0.0096
Loa Loa (eye worm) hypothetical protein 0.00250592 0.5 0.5
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0298 0.1135 1
Echinococcus multilocularis FTZ F1 alpha 0.0025 0.0055 0.0052
Loa Loa (eye worm) MH2 domain-containing protein 0.0121 0.0436 0.7872
Trichomonas vaginalis PIKK family atypical protein kinase 0.0072 0.024 0.7663
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0035 0.0221
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0025 0.0055 0.0987
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.00250592 0.5 0.5
Loa Loa (eye worm) hypothetical protein 0.0013 0.0008 0.0141
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.009 0.0314 0.0571
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0048 0.0145 0.0261
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0035 0.0312
Brugia malayi photoreceptor-specific nuclear receptor 0.0025 0.0055 0.0951
Schistosoma mansoni hypothetical protein 0.0048 0.0145 0.0261
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0051 0.0157 0.1388
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.002 0.0035 0.0639
Toxoplasma gondii target of rapamycin (TOR), putative 0.0067 0.0222 1
Echinococcus granulosus serine protein kinase ATM 0.0017 0.0023 0.0038
Brugia malayi nuclear receptor RXR 0.0013 0.0008 0.0102
Trichomonas vaginalis PIKK family atypical protein kinase 0.0017 0.0023 0.0737
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0035 0.0221
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.00250592 0.5 0.5
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0042 0.0121 0.1068
Schistosoma mansoni RAR-like nuclear receptor 0.00250592 0.5 0.5
Loa Loa (eye worm) hypothetical protein 0.0025 0.0055 0.0987
Loa Loa (eye worm) hypothetical protein 0.0012 0.0002 0.0039
Schistosoma mansoni hypothetical protein 0.0013 0.0008 0.001
Brugia malayi ImpB/MucB/SamB family protein 0.002 0.0035 0.0602
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.009 0.0314 0.5651
Brugia malayi photoreceptor-specific nuclear receptor 0.00250592 0.5 0.5
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0025 0.0055 0.0951
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.003 0.0076 0.0073
Loa Loa (eye worm) hypothetical protein 0.0012 0.0002 0.0039
Leishmania major phosphatidylinositol 3-kinase, putative 0.003 0.0076 0.0365
Loa Loa (eye worm) transcription factor SMAD2 0.0121 0.0436 0.7872
Schistosoma mansoni retinoic acid receptor RXR 0.00250592 0.5 0.5
Echinococcus multilocularis thyroid hormone receptor alpha 0.00250592 0.5 0.5
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0035 0.0312
Loa Loa (eye worm) hypothetical protein 0.0025 0.0055 0.0987
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0035 0.0312
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0025 0.0055 0.0096
Schistosoma mansoni hypothetical protein 0.0048 0.0145 0.0261
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0017 0.0023 0.038
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0042 0.0121 0.1068
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0025 0.0055 0.0951
Loa Loa (eye worm) phosphatidylinositol 3 0.009 0.0314 0.5668
Echinococcus multilocularis tar DNA binding protein 0.0127 0.0458 0.0455
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0013 0.0008 0.001
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0013 0.0008 0.001
Brugia malayi nuclear hormone receptor 0.0025 0.0055 0.0951
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0035 0.0221
Echinococcus multilocularis cpg binding protein 0.0032 0.0081 0.0079

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) NOVARTIS: Antimalarial liver stage activity measured as a greater than 50% reduction in Plasmodium yoelii schizont area in HepG2-A16-CD81 cells at 10uM compound concentration, determined by immuno-fluorescence. ChEMBL. 22096101
CC50 (functional) > 10 uM Huh7 cytotoxicity for Pf inhibitors Novartis-GNF Malaria Box. No reference
CC50 > 10 uM NOVARTIS: Cytotoxicity against human hepatocellular carcinoma cell line (Huh7) ChEMBL. 18579783
EC50 (functional) > 1.203 uM PF proliferation inhibition 3D7 Novartis-GNF Malaria Box. No reference
EC50 (functional) > 1.203 uM NOVARTIS: Inhibition of Plasmodium falciparum 3D7 (drug-susceptible) proliferation in erythrocyte-based infection assay ChEMBL. 18579783
EC50 (functional) > 1.541 uM W2 Pf proliferation inhibition Novartis-GNF Malaria Box. No reference
EC50 (functional) > 1.541 uM NOVARTIS: Inhibition of Plasmodium falciparum W2 (drug-resistant) proliferation in erythrocyte-based infection assay ChEMBL. 18579783
IFI promiscuity index = 0 IFI promiscuity index Novartis-GNF Malaria Box. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23 18579783

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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